[(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-morpholin-4-ylpyridine-3-carboxylate

Systemtic Name: [(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-morpholin-4-ylpyridine-3-carboxylate Openeye Name: [(1S)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl] 6-morpholinopyridine-3-carboxylate CAS Name: 6-(4-morpholinyl)-3-pyridinecarboxylic acid [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 6-morpholin-4-ylpyridine-3-carboxylate Traditional Name: 6-morpholinonicotinic acid [(1S)-2-keto-1-methyl-2-p-phenetyl-ethyl] ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CN=C(C=C2)N3CCOCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CN=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H24N2O5/c1-3-27-18-7-4-16(5-8-18)20(24)15(2)28-21(25)17-6-9-19(22-14-17)23-10-12-26-13-11-23/h4-9,14-15H,3,10-13H2,1-2H3/t15-/m0/s1